CTK1H3528
TL;DR: CTK1H3528 (CAS 52762-72-8) is a chemical compound with molecular formula C27H23BrN4S2 and molecular weight 546.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-ethyl-2-[3-(3-ethyl-[1,3]thiazolo[4,5-b]quinolin-3-ium-2-yl)prop-2-enylidene]-[1,3]thiazolo[4,5-b]quinoline bromide
Also Known As: 3-Ethyl-2-[3-(3-ethyl[1,3]thiazolo[4,5-b]quinolin-2(3H)-ylidene)prop-1-en-1-yl][1,3]thiazolo[4,5-b]quinolin-3-ium bromide, Thiazolo(4,5-b)quinolinium, 3-ethyl-2-(3-(3-ethylthiazolo(4,5-b)quinolin-2(3H)-ylidene)-1-propenyl)-, bromide
| Molecular Formula | C27H23BrN4S2 |
|---|---|
| Molecular Weight | 546.05 g/mol |
| LogP | 3.7959 |
| Topological Polar Surface Area | 86.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 546.05475 |
| Heavy Atoms | 34 |
| Complexity | 696.0 |
Chemical Identifiers
| CAS Number | 52762-72-8 |
|---|---|
| SMILES | CCN1C(=CC=CC2=[N+](C3=NC4=CC=CC=C4C=C3S2)CC)SC5=CC6=CC=CC=C6N=C51.[Br-] |
| InChIKey | ZESFQPAXLPWUQL-UHFFFAOYSA-M |
Product Overview
CTK1H3528 (CAS 52762-72-8), with molecular formula C27H23BrN4S2 and molecular weight 546.05 g/mol. IUPAC: 3-ethyl-2-[3-(3-ethyl-[1,3]thiazolo[4,5-b]quinolin-3-ium-2-yl)prop-2-enylidene]-[1,3]thiazolo[4,5-b]quinoline bromide.
Chemical Property Profile of CTK1H3528
Property Insights of CTK1H3528
The XLogP value of 3.7959 indicates that CTK1H3528 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.4 Ų falls within the moderate polarity range, balancing permeability and solubility for CTK1H3528. Following Lipinski's Rule of Five, CTK1H3528 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of CTK1H3528?
The CAS number of CTK1H3528 is 52762-72-8.
What is the molecular formula of CTK1H3528?
The molecular formula of CTK1H3528 is C27H23BrN4S2.
What is the molecular weight of CTK1H3528?
The molecular weight of CTK1H3528 is 546.05 g/mol.
Where can I buy CTK1H3528?
You can request a quote for CTK1H3528 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CTK1H3528?
Yes, KEHONG BIO provides custom synthesis services for CTK1H3528 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.